| Properties | Image |
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| MNX_ID | MNXM1039133 |
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| reference | slm:000731522 |
| formula | C69H125NO8P |
| global charge | -1 |
| mol weight | 1127.732 |
| InChIKey | KQRYXWOTZLNIQG-BOUXNMONSA-M |
| InChI | InChI=1S/C69H126NO8P/c1-4-7-10-13-16-18-20-22-24-26-28-30-31-32-33-34-35-36-38-40-42-44-46-48-50-53-56-59-63-75-65-67(66-77-79(73,74)76-64-62-70-68(71)60-57-54-51-15-12-9-6-3)78-69(72)61-58-55-52-49-47-45-43-41-39-37-29-27-25-23-21-19-17-14-11-8-5-2/h8,11,17,19,23,25,29,37,41,43,47,49,67H,4-7,9-10,12-16,18,20-22,24,26-28,30-36,38-40,42,44-46,48,50-66H2,1-3H3,(H,70,71)(H,73,74)/p-1/b11-8-,19-17-,25-23-,37-29-,43-41-,49-47-/t67-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C69H126NO8P/c1-4-7-10-13-16-18-20-22-24-26-28-30-31-32-33-34-35-36-38-40-42-44-46-48-50-53-56-59-63-75-65-67(66-77-79(73,74)76-64-62-70-68(71)60-57-54-51-15-12-9-6-3)78-69(72)61-58-55-52-49-47-45-43-41-39-37-29-27-25-23-21-19-17-14-11-8-5-2/h8,11,17,19,23,25,29,37,41,43,47,49,67H,4-7,9-10,12-16,18,20-22,24,26-28,30-36,38-40,42,44-46,48,50-66H2,1-3H3,(H,70,71)(H,73,74)/b11-8-,19-17-,25-23-,37-29-,43-41-,49-47-/t67-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:18][CH2:20][CH2:22][CH2:24][CH2:26][CH2:28][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][CH2:53][CH2:56][CH2:59][CH2:63][O:75][CH2:65][C@H:67]([CH2:66][O:77][P:79]([OH:73])(=[O:74])[O:76][CH2:64][CH2:62][N:70]=[C:68]([CH2:60][CH2:57][CH2:54][CH2:51][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:71])[O:78][C:69]([CH2:61][CH2:58][CH2:55][CH2:52]/[CH:49]=[CH:47]\[CH2:45]/[CH:43]=[CH:41]\[CH2:39]/[CH:37]=[CH:29]\[CH2:27]/[CH:25]=[CH:23]\[CH2:21]/[CH:19]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:72] |
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